bis(4-isothiocyanato-3-methyl-phenyl)methanone

Systemtic Name: bis(4-isothiocyanato-3-methyl-phenyl)methanone Openeye Name: bis(4-isothiocyanato-3-methyl-phenyl)methanone CAS Name: bis(4-isothiocyanato-3-methylphenyl)methanone IUPAC Name: bis(4-isothiocyanato-3-methylphenyl)methanone Traditional Name: bis(4-isothiocyanato-3-methyl-phenyl)methanone Formula: C17H12N2OS2 MolecularWeight: 324.41998

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)C(=O)C2=CC(=C(C=C2)N=C=S)C)N=C=S

Isomeric SMILES

CC1=C(C=CC(=C1)C(=O)C2=CC(=C(C=C2)N=C=S)C)N=C=S

InChI

InChI=1S/C17H12N2OS2/c1-11-7-13(3-5-15(11)18-9-21)17(20)14-4-6-16(19-10-22)12(2)8-14/h3-8H,1-2H3